N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride

C7H16ClN3O2 — CID 21289595

IUPACN-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride
SMILESCl.NCCNC(=O)N1CCOCC1
InChIInChI=1S/C7H15N3O2.ClH/c8-1-2-9-7(11)10-3-5-12-6-4-10;/h1-6,8H2,(H,9,11);1H
InChIKeyIBHMRVSCIXUNHL-UHFFFAOYSA-N
MW209.68 g/mol
LogP-0.59
Rot. Bonds2

About N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride

N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride (PubChem CID 21289595) has the molecular formula C7H16ClN3O2 and a molecular weight of 209.68 g/mol. Its IUPAC name is N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride
PubChem CID21289595
Molecular FormulaC7H16ClN3O2
Molecular Weight209.68 g/mol
Exact Mass209.09
IUPAC NameN-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride
SMILESCl.NCCNC(=O)N1CCOCC1
InChIInChI=1S/C7H15N3O2.ClH/c8-1-2-9-7(11)10-3-5-12-6-4-10;/h1-6,8H2,(H,9,11);1H
InChIKeyIBHMRVSCIXUNHL-UHFFFAOYSA-N
XLogP-0.59
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.68
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride (CID 21289595) is N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride is Cl.NCCNC(=O)N1CCOCC1.
What is the InChIKey of N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride?
The InChIKey is IBHMRVSCIXUNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2.ClH/c8-1-2-9-7(11)10-3-5-12-6-4-10;/h1-6,8H2,(H,9,11);1H.
What are the key properties of N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride?
N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride has a molecular weight of 209.68 g/mol, XLogP of -0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)morpholine-4-carboxamide;hydrochloride is sourced from PubChem (CID 21289595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).